SCHEMBL6574367

SCHEMBL6574367

N#CC1(c2cncc(Cl)c2)CC2CCC(C1)N2

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CHRNB4 P30926 1/20 0.39
CHRNA3 P32297 1/20 0.39
SLC6A4 P31645 2/20 0.33
SLC6A3 Q01959 2/20 0.33
CHRNB2 P17787 6/20 0.32
CHRNA4 P43681 6/20 0.32
CYP11B1 P15538 2/20 0.32
CYP11B2 P19099 2/20 0.32

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL16135470 1.00 CHRNB4 (0.39) CHRNB4CHRNA3SLC6A4SLC6A3CHRNB2
SCHEMBL6617405 0.94 CHRNB4 (0.38) CHRNB4CHRNA3SLC6A4SLC6A3CHRNB2
SCHEMBL17507209 0.86 CHRNB2 (0.36) CHRNB4CHRNA3SLC6A4SLC6A3CHRNB2
SCHEMBL7698407 0.86 CHRNB2 (0.36) CHRNB4CHRNA3SLC6A4SLC6A3CHRNB2
SCHEMBL17507211 0.86 CHRNB2 (0.36) CHRNB4CHRNA3SLC6A4SLC6A3CHRNB2
SCHEMBL16115008 0.86 CHRNB2 (0.36) CHRNB4CHRNA3SLC6A4SLC6A3CHRNB2
SCHEMBL17940856 0.83 KDM4E (0.31) CHRNB2CHRNA4
SCHEMBL16565778 0.83 KDM4E (0.31) CHRNB2CHRNA4
SCHEMBL16115777 0.83
SCHEMBL16135495 0.83

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 19 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0944319-A1 INSECTICIDAL COMPOSITIONS AND METHODS ZENECA LIMITED (GB) 1999-09-29 EP claimed
WO-1998023158-A1 INSECTICIDAL COMPOSITIONS AND METHODS ZENECA LIMITED (GB) 1998-06-04 WO claimed
EP-2770831-B1 1,3-DIARYL-SUBSTITUTED HETEROCYCLIC PESTICIDES DU PONT (US) 2017-11-22 EP disclosed
EP-0901490-B1 BICYCLIC AMINES AS INSECTICIDES SYNGENTA LTD (GB) 2004-04-07 EP disclosed
EP-0944627-B1 8-AZABICYCLO 3.2.1]OCTANE-, 8-AZABICYCLO 3.2.1]OCT-6-ENE-, 9-AZABICYCLO 3.3.1]NONANE-, 9-AZA-3-OXABICYCLO 3.3.1]NONANE- AND 9-AZA-3-THIABICYCLO 3.3.1]NONANE DERIVATIVES, THEIR PREPARATION AND THEIR USE AS INSECTICIDES SYNGENTA LTD (GB) 2004-02-18 EP disclosed
US-6573275-B1 Insecticidal compositions comprising and to methods of combatting and controlling insect pests therewith. SYNGENTA LIMITED (GB) 2003-06-03 US disclosed
EP-0946553-B1 8-AZABICYCLO 3.2.1]OCTANE DERIVATIVES, THEIR PREPARATION AND THEIR USE AS INSECTICIDES SYNGENTA LTD (GB) 2003-01-29 EP disclosed
EP-0828739-B1 BICYCLIC AMINES AS INSECTICIDES SYNGENTA LTD (GB) 2002-09-11 EP disclosed
US-6391883-B1 INSECTICIDES SYNGENTA LIMITED (GB) 2002-05-21 US disclosed
US-6207676-B1 Bicyclic amines ZENECA LIMITED (GB) 2001-03-27 US disclosed
US-6066646-A INSECTICIDAL, ACARICIDAL OR NEMATICIDAL COMPOSITION ZENECA LIMITED (GB) 2000-05-23 US disclosed
EP-0944625-A1 8-AZABICYCLO 3.2.1]OCTANE-, 8-AZABICYCLO 3.2.1]OCT-6-ENE-, 9-AZABICYCLO 3.3.1]NONANE-, 9-AZA-3-OXABICYCLO 3.3.1]NONANE-, 9-AZA-3-THIABICYCLO 3.3.1]NONANE DERIVATIVES, THEIR PREPARATION AND THEIR USE AS INSECTICIDES ZENECA LIMITED (GB) 1999-09-29 EP disclosed
EP-0944319-A1 INSECTICIDAL COMPOSITIONS AND METHODS ZENECA LIMITED (GB) 1999-09-29 EP disclosed
EP-0901490-A1 BICYCLIC AMINES AS INSECTICIDES ZENECA LIMITED (GB) 1999-03-17 EP disclosed
WO-1998023158-A1 INSECTICIDAL COMPOSITIONS AND METHODS ZENECA LIMITED (GB) 1998-06-04 WO disclosed
WO-1998022462-A1 8-AZABICYCLO[3.2.1]OCTANE-, 8-AZABICYCLO[3.2.1]OCT-6-ENE-, 9-AZABICYCLO[3.3.1]NONANE-, 9-AZA-3-OXABICYCLO[3.3.1]NONANE-, 9-AZA-3-THIABICYCLO[3.3.1]NONANE DERIVATIVES, THEIR PREPARATION AND THEIR USE AS INSECTICIDES ZENECA LIMITED (GB) 1998-05-28 WO disclosed
EP-0828739-A1 BICYCLIC AMINES AS INSECTICIDES ZENECA LIMITED (GB) 1998-03-18 EP disclosed
WO-1997043286-A1 BICYCLIC AMINES AS INSECTICIDES ZENECA LIMITED (GB) 1997-11-20 WO disclosed
WO-1996037494-A1 BICYCLIC AMINES AS INSECTICIDES ZENECA LIMITED (GB) 1996-11-28 WO disclosed